Showing results (11-20 of 424) with videos related to
Sort By:
Pageof 43
The Journal of Chemical Physics|February 13, 2024
COMPASS: Double-ended saddle point search as a constrained optimization problemMartin Sommer-Jörgensen, Stefan GoedeckerThe Journal of Chemical Physics|July 13, 2011
An enhanced splined saddle methodS Alireza Ghasemi, Stefan GoedeckerPhysical Review. E, Statistical, Nonlinear, and Soft Matter Physics|July 23, 2008
Bell-Evans-Polanyi principle for molecular dynamics trajectories and its implications for global optimizationShantanu Roy, Stefan Goedecker, Vladimir HellmannScientific Reports|August 10, 2017
Metastable exohedrally decorated Borospherene B<sub>40</sub>Santanu Saha, Luigi Genovese, Stefan GoedeckerThe Journal of Chemical Physics|February 2, 2011
Efficient moves for global geometry optimization methods and their application to binary systemsMichael Sicher, Stephan Mohr, Stefan GoedeckerPhysical Review Letters|August 11, 2005
Global minimum determination of the Born-Oppenheimer surface within density functional theoryStefan Goedecker, Waldemar Hellmann, Thomas LenoskyPhysical Review Letters|June 13, 2002
A fourfold coordinated point defect in siliconStefan Goedecker, Thierry Deutsch, Luc BillardThe Journal of Chemical Physics|August 11, 2007
Efficient and accurate three-dimensional Poisson solver for surface problemsLuigi Genovese, Thierry Deutsch, Stefan GoedeckerPlant Physiology|March 10, 1998
Identification of a Role for an Azide-Sensitive Factor in the Thylakoid Transport of the 17-Kilodalton Subunit of the Photosynthetic Oxygen-Evolving ComplexLeheny, Teter, ThegThe Journal of Chemical Physics|December 18, 2007
A particle-particle, particle-density algorithm for the calculation of electrostatic interactions of particles with slablike geometryS Alireza Ghasemi, Alexey Neelov, Stefan GoedeckerPageof 43